Vitas-M small molecule compound

4-ethyl 2-methyl 5-{[(Z)-2-cyano-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}ethenyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK803899
SMILES CCOC(=O)c1c(N/C=C(\c2scc(n2)c2ccc(cc2)CC(C)C)/C#N)sc(c1C)C(=O)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H27N3O4S2 MW 509.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O4S2/c1-6-33-25(30)21-16(4)22(26(31)32-5)35-24(21)28-13-19(12-27)23-29-20(14-34-23)18-9-7-17(8-10-18)11-15(2)3/h7-10,13-15,28H,6,11H2,1-5H3/b19-13-
InChIKey
VWRADIMJVLVXKM-UYRXBGFRSA-N
Synonyms
585560-55-0
(Z)4ethyl2methyl5((2cyano2(4(4isobutylphenyl)thiazol2yl)vinyl)amino)3methylthiophene24dicarboxylate
4ethyl2methyl5(((Z)2cyano2(4(4(2methylpropyl)phenyl)13thiazol2yl)ethenyl)amino)3methylthiophene24dicarboxylate
4OETHYL2OMETHYL5(((Z)2CYANO2(4(4(2METHYLPROPYL)PHENYL)13THIAZOL2YL)ETHENYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
585560550
CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)CC(C)C
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc(cc2)CC(C)C)C#N)sc(c1C)C(=O)OC
InChI=1SC26H27N3O4S2c163325(30)2116(4)22(26(31)325)3524(21)281319(1227)232920(143423)189717(81018)1115(2)3h710131528H611H215H3b1913
MFCD04028420
ZINC000002384200
ZINC02384200
ZINC2384200

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Available files

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